ChemSpider 2D Image | Octoxinol 9 | C32H58O10

Octoxinol 9

  • Molecular FormulaC32H58O10
  • Average mass602.797 Da
  • Monoisotopic mass602.403015 Da
  • ChemSpider ID400272

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

26-[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]-3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol [ACD/IUPAC Name]
26-[4-(2,4,4-Trimethyl-2-pentanyl)phenoxy]-3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol [German] [ACD/IUPAC Name]
26-[4-(2,4,4-Triméthyl-2-pentanyl)phénoxy]-3,6,9,12,15,18,21,24-octaoxahexacosan-1-ol [French] [ACD/IUPAC Name]
3,6,9,12,15,18,21,24-Octaoxahexacosan-1-ol, 26-[4-(1,1,3,3-tetramethylbutyl)phenoxy]- [ACD/Index Name]
Octoxinol 9
2315-65-3 [RN]
EGC

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS004807 [DBID]
AIDS-004807 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 638.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 99.1±3.0 kJ/mol
Flash Point: 339.7±31.5 °C
Index of Refraction: 1.482
Molar Refractivity: 164.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 2
ACD/LogP: 2.02
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 41.94
ACD/KOC (pH 5.5): 504.76
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 41.94
ACD/KOC (pH 7.4): 504.76
Polar Surface Area: 103 Å2
Polarizability: 65.0±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 575.2±3.0 cm3

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